CID 6410482

Brn 0928938

Structural Information

Molecular Formula
C18H15ClN4O
SMILES
CC1=CC(=NN=C1NNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3
InChI
InChI=1S/C18H15ClN4O/c1-12-11-16(13-5-3-2-4-6-13)20-21-17(12)22-23-18(24)14-7-9-15(19)10-8-14/h2-11H,1H3,(H,21,22)(H,23,24)
InChIKey
IYGHKWIMGRAXLP-UHFFFAOYSA-N
Compound name
4-chloro-N'-(4-methyl-6-phenylpyridazin-3-yl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.09344 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.10072 178.2
[M+Na]+ 361.08266 186.1
[M-H]- 337.08616 185.3
[M+NH4]+ 356.12726 188.9
[M+K]+ 377.05660 179.0
[M+H-H2O]+ 321.09070 167.7
[M+HCOO]- 383.09164 196.6
[M+CH3COO]- 397.10729 188.3
[M+Na-2H]- 359.06811 184.0
[M]+ 338.09289 179.2
[M]- 338.09399 179.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.